Products 16298-90-1

CAS 16298-90-1 is the registry number for Jesaconitine. Offered by: Biosynth, MedChemExpress. Available pack sizes: 1mg, 1 mg, 5 mg.

Jesaconitine
Biosynth, MedChemExpress
  • size: 1mg, 1 mg, 5 mg
  • Variants: 3
from 1624.66
View product
Structural formula: {0} (CAS {1})

[(1S,2R,3R,4R,5R,6S,7S,8R,9R,10R,13R,14R,16S,17S,18R)-8-acetyloxy-11-ethyl-5,7,14-trihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] 4-methoxybenzoate (CAS 16298-90-1) is a chemical compound with the molecular formula C35H49NO12 and a molecular weight of 675.8 g/mol. IUPAC name: [(1S,2R,3R,4R,5R,6S,7S,8R,9R,10R,13R,14R,16S,17S,18R)-8-acetyloxy-11-ethyl-5,7,14-trihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] 4-methoxybenzoate. InChIKey: MGTJNQWIXFSPLC-DMCHUPBKSA-N.

Identity
Molecular formulaC35H49NO12
Molecular weight675.8 g/mol
IUPAC name[(1S,2R,3R,4R,5R,6S,7S,8R,9R,10R,13R,14R,16S,17S,18R)-8-acetyloxy-11-ethyl-5,7,14-trihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] 4-methoxybenzoate
InChIKeyMGTJNQWIXFSPLC-DMCHUPBKSA-N
SMILESCCN1C[C@@]2([C@@H](C[C@@H]([C@@]34[C@@H]2[C@H]([C@@H]([C@H]31)[C@@]5([C@@H]6[C@H]4C[C@@]([C@@H]6OC(=O)C7=CC=C(C=C7)OC)([C@H]([C@@H]5O)OC)O)OC(=O)C)OC)OC)O)COC

Computed by PubChem (NCBI)

Synonyms: Diesaconitine, JESACONITINE, JESACONITINE [MI], orb1703334